4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]sulfonylbenzenesulfonamide Openeye Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]sulfonylbenzenesulfonamide CAS Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: 4-[4-(1,3-benzothiazol-2-yl)piperazino]sulfonylbenzenesulfonamide Formula: C17H18N4O4S3 MolecularWeight: 438.54422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C17H18N4O4S3/c18-27(22,23)13-5-7-14(8-6-13)28(24,25)21-11-9-20(10-12-21)17-19-15-3-1-2-4-16(15)26-17/h1-8H,9-12H2,(H2,18,22,23)